2-Isopropyl-3-methoxy-5,6-dimethylpyrazine
Basic information
- CAS
128600-00-0- Standard SMILES
COc1nc(C)c(C)nc1C(C)C- InChIKey
IIAWZEWLMSEQTH-UHFFFAOYSA-N- Molecular formula
- C10H16N2O
- Average molar mass
- 180.25 g/mol
- Monoisotopic mass
- 180.12626314
Names & identifiers
- Preferred name
- 2-Isopropyl-3-methoxy-5,6-dimethylpyrazine
- IUPAC
- 2-methoxy-5,6-dimethyl-3-propan-2-ylpyrazine
- English name
- Pyrazine, 2-methoxy-5,6-dimethyl-3-(1-methylethyl)- (9CI)
- Molecular formula
- C10H16N2O
- Molecular weight
- 180.24684
Names & synonyms
128600-00-02-Isopropyl-3-methoxy-5,6-dimethylpyrazine2-Methoxy-5,6-dimethyl-3-(propan-2-yl)pyrazineDTXSID80668122DB-278054PYRAZINE, 2-METHOXY-5,6-DIMETHYL-3-(1-METHYLETHYL)-2-METHOXY-5,6-DIMETHYL-3-(1-METHYLETHYL)PYRAZINEPyrazine, 2-methoxy-5,6-dimethyl-3-(1-methylethyl)- (9CI)
Database identifiers
- CAS
128600-00-0- PubChem CID
- 45099786
- DTXSID
DTXSID80668122
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 161
Physicochemical properties
- Comptox DTXSID
- 80668122 · DTXSID80668122
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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